The geometric, electronic, magnetic and optical properties of lithium, aluminium, iron, and part of sodium, potassium, magnesium-ion-based batteries are covered, in addition to different cathode, electrolyte and anode materials. The various quasiparticle phenomena of charge and spin dominate the whole featured-rich properties of ion-based battery compounds.
Methods for evaluating and analysing the first-principles results are discussed in detail, which can be generalized to excitonic effects in other emergent materials. The book also surveys the potential for engineering integration, future applications, and the present condition of the Li-ion battery industry.
The text is ideal as a reference for researchers and senior graduate students working on the theory and fundamental science of battery materials. It will also be useful for materials scientists and condensed matter physicists studying diverse crucial material properties.
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